relax SVN archive

Molecular dynamics by NMR data analysis

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Commit [r14977] Maximize Restore History

Changes for the isotropic cone, free rotor frame order test data.

The distribution of structures consists of 5000 rather than 500 models now, so the PDB file is no
longer stored. This number is needed to properly sample the space. Monte Carlo simulations have
also been added.

Authored by: bugman 2011-11-07

Browse code at this revision

Parent: [r14976]

Child: [r14978]

changed	/1.3/test_suite/shared_data/frame_order/iso_cone_free_rotor/README
changed	/1.3/test_suite/shared_data/frame_order/iso_cone_free_rotor/animate.py
changed	/1.3/test_suite/shared_data/frame_order/iso_cone_free_rotor/ave_pos.pdb
changed	/1.3/test_suite/shared_data/frame_order/iso_cone_free_rotor/back_calc.bz2
changed	/1.3/test_suite/shared_data/frame_order/iso_cone_free_rotor/cone.pdb
removed	/1.3/test_suite/shared_data/frame_order/iso_cone_free_rotor/distribution.pdb.gz
changed	/1.3/test_suite/shared_data/frame_order/iso_cone_free_rotor/frame_order.bz2
changed	/1.3/test_suite/shared_data/frame_order/iso_cone_free_rotor/frame_order.log.bz2
changed	/1.3/test_suite/shared_data/frame_order/iso_cone_free_rotor/frame_order.py
removed	/1.3/test_suite/shared_data/frame_order/iso_cone_free_rotor/generate_distribution.log
added	/1.3/test_suite/shared_data/frame_order/iso_cone_free_rotor/generate_distribution.log.bz2
changed	/1.3/test_suite/shared_data/frame_order/iso_cone_free_rotor/generate_distribution.py
changed	/1.3/test_suite/shared_data/frame_order/iso_cone_free_rotor/pcs_dy.txt
changed	/1.3/test_suite/shared_data/frame_order/iso_cone_free_rotor/pcs_er.txt
changed	/1.3/test_suite/shared_data/frame_order/iso_cone_free_rotor/pcs_tb.txt
changed	/1.3/test_suite/shared_data/frame_order/iso_cone_free_rotor/pcs_tm.txt
changed	/1.3/test_suite/shared_data/frame_order/iso_cone_free_rotor/rdc_dy.txt
changed	/1.3/test_suite/shared_data/frame_order/iso_cone_free_rotor/rdc_er.txt
changed	/1.3/test_suite/shared_data/frame_order/iso_cone_free_rotor/rdc_tb.txt
changed	/1.3/test_suite/shared_data/frame_order/iso_cone_free_rotor/rdc_tm.txt
changed	/1.3/test_suite/shared_data/frame_order/iso_cone_free_rotor/tensor_fit.log.bz2
changed	/1.3/test_suite/shared_data/frame_order/iso_cone_free_rotor/tensors.py